C18H10Cl2N6O
TL;DR: C18H10Cl2N6O (CAS 848756-06-9) is a chemical compound with molecular formula C18H10Cl2N6O and molecular weight 396.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[10-(3,4-dichlorophenyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl]phenol
Also Known As: 2-[3-(3,4-Dichlorophenyl)-6-hydropyrazolo[5,4-d]1,2,4-triazolo[1,5-e]pyrimidin-8-yl]phenol, 2-(7-(3,4-dichlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol, 2-[7-(3,4-dichlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol, 2-[3-(3,4-dichlorophenyl)-6-hydropyrazolo[5,4-d]1,2,4-triazolo[1,5-e]pyrimidin -8-yl]phenol
| Molecular Formula | C18H10Cl2N6O |
|---|---|
| Molecular Weight | 396.03 g/mol |
| LogP | 4.1426 |
| Topological Polar Surface Area | 81.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 396.02933 |
| Heavy Atoms | 27 |
| Complexity | 1326.4468 |
Chemical Identifiers
| CAS Number | 848756-06-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NN3C=NC4=C(C3=N2)C=NN4C5=CC(=C(C=C5)Cl)Cl)O |
Product Overview
C18H10Cl2N6O (CAS 848756-06-9), with molecular formula C18H10Cl2N6O and molecular weight 396.03 g/mol. IUPAC: 2-[10-(3,4-dichlorophenyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl]phenol.
Chemical Property Profile of C18H10Cl2N6O
Property Insights of C18H10Cl2N6O
The XLogP value of 4.1426 indicates that C18H10Cl2N6O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.13 Ų falls within the moderate polarity range, balancing permeability and solubility for C18H10Cl2N6O. Following Lipinski's Rule of Five, C18H10Cl2N6O has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C18H10Cl2N6O?
The CAS number of C18H10Cl2N6O is 848756-06-9.
What is the molecular formula of C18H10Cl2N6O?
The molecular formula of C18H10Cl2N6O is C18H10Cl2N6O.
What is the molecular weight of C18H10Cl2N6O?
The molecular weight of C18H10Cl2N6O is 396.03 g/mol.
Where can I buy C18H10Cl2N6O?
You can request a quote for C18H10Cl2N6O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C18H10Cl2N6O?
Yes, KEHONG BIO provides custom synthesis services for C18H10Cl2N6O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.